Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.41 |
| ▸ | BAD | Q92934 | 1/20 | 0.41 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28763087 | 0.81 | HPRT1 (0.43) | ALDH1A1HPGDKDM4EMEN1MAPT | |
| SCHEMBL28802239 | 0.78 | PNMT (0.58) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL15741582 | 0.76 | ALDH1A1 (0.56) | ALDH1A1HPGDKDM4EMEN1MAPT | |
| SCHEMBL30513686 | 0.76 | BCL2L1 (0.56) | ALDH1A1HPGDKDM4EMEN1MAPT | |
| SCHEMBL751800 | 0.76 | BCL2L1 (0.56) | ALDH1A1HPGDKDM4EMEN1MAPT | |
| SCHEMBL21176632 | 0.76 | HPRT1 (0.54) | ALDH1A1MAPTTSHRHSD17B10TDP1 | |
| SCHEMBL30928215 | 0.76 | HPRT1 (0.54) | ALDH1A1MAPTTSHRHSD17B10TDP1 | |
| SCHEMBL2089665 | 0.76 | HPRT1 (0.54) | ALDH1A1MAPTTSHRHSD17B10TDP1 | |
| SCHEMBL14876644 | 0.74 | ALDH1A1 (0.87) | ALDH1A1HPGDKDM4EMEN1MAPT | |
| SCHEMBL16107418 | 0.74 | ALDH1A1 (0.87) | ALDH1A1HPGDKDM4EMEN1MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108498520-A | A kind of pharmaceutical composition and preparation method thereof for treating periodontitis | 戚建民 | 2018-09-07 | — | — | CN | claimed |
| CN-108498520-A | A kind of pharmaceutical composition and preparation method thereof for treating periodontitis | 戚建民 | 2018-09-07 | — | — | CN | disclosed |
| CN-103987694-B | Colour coupler with the tetrahydroquinoline structure of 7 amino 1,2,3,4, the colouring compositions comprising them, method and purposes | 莱雅公司 | 2017-10-13 | — | — | CN | disclosed |
| CN-1324008-C | Novel compounds and compositions as cathepsin inhibitors | AVENTIS PHARMA INC (US) | 2007-07-04 | — | — | CN | disclosed |
| CN-1553892-A | Novel compounds and compositions as cathepsin inhibitors | ����˹��ҩ�﹫˾ | 2004-12-08 | — | — | CN | disclosed |
| CN-1512983-A | Compounds and compositions as cathepsins inhibitors | AXYSҩ�﹫˾ | 2004-07-14 | — | — | CN | disclosed |